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Crystal structure of the ig-pH domain of actin-binding protein SCAB1

Analyse Crystal structure of the ig-pH domain of actin-binding protein SCAB1 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4DIX
Type
protein
Length
424 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Plectin-related protein
UniProt
O48791
Pockets
4 · best druggability 0.53

Structure

x-ray diffraction · 1 distinct chain · 17% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPlectin-related proteinprotein21217% helix, 45% strandO48791

Ligands and binding sites

  • MLI · Malonate ion · additive · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11090.530.8227empty
2950.500.8320empty
31070.370.7426empty
4530.260.7316empty

Interfaces

1 interface between chains.

  • A–B · 615 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 4DIX · Crystal structure of the Ig-PH domain of actin-binding protein SCAB1 · the same entry in another collection · chain A against A, TM-score 1.00
  • O48791 · AlphaFold monomer V2.0 prediction for stomatal closure-related actin- binding protein 1… · a predicted model of the same protein · chain A against A, TM-score 1.00

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